SCHEMBL7143587

SCHEMBL7143587

CCCCNC(=S)Nc1ccc(F)c([Ti])c1F

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 7/20 0.62
KMT2A Q03164 6/20 0.52
LMNA P02545 8/20 0.50
ALDH1A1 P00352 5/20 0.48
MEN1 O00255 3/20 0.48
HPGD P15428 2/20 0.48
ALOX12 P18054 2/20 0.48
EPHX2 P34913 1/20 0.48
CYP1A2 P05177 1/20 0.48
POLB P06746 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
HTT P42858 8/20 0.47
MAPT P10636 4/20 0.44
RECQL P46063 1/20 0.43
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
GAA P10253 2/20 0.42
NPSR1 Q6W5P4 1/20 0.42

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL27515371 0.83 EPHX2 (0.41) SMN1; SMN2KMT2ALMNAALDH1A1MEN1
SCHEMBL4355850 0.78 SMN1; SMN2 (0.58) SMN1; SMN2KMT2ALMNAALDH1A1MEN1
SCHEMBL7580934 0.77 CETP (0.48) ALDH1A1HPGDEPHX2POLBGAA
SCHEMBL29104892 0.75 SMN1; SMN2 (0.55) SMN1; SMN2KMT2ALMNAALDH1A1MEN1
SCHEMBL27782813 0.73 SMN1; SMN2 (0.76) SMN1; SMN2KMT2ALMNAALDH1A1MEN1
SCHEMBL483182 0.73 SMN1; SMN2 (0.52) SMN1; SMN2KMT2ALMNAALDH1A1MEN1
SCHEMBL27527865 0.72 EPHX2 (0.39) SMN1; SMN2KMT2ALMNAALDH1A1MEN1
SCHEMBL27515874 0.72 EPHX2 (0.47) SMN1; SMN2KMT2ALMNAMEN1EPHX2
SCHEMBL15894091 0.71 LMNA (0.83) SMN1; SMN2KMT2ALMNAALDH1A1MEN1
SCHEMBL16320691 0.71 SMN1; SMN2 (0.89) SMN1; SMN2KMT2ALMNAALDH1A1MEN1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030190554-A1 Photopolymerization; development using alkalinity developer FUJIFILM CORPORATION (JP) 2003-10-09 US disclosed